methyl (2R,3S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-pentanoate

Systemtic Name: methyl (2R,3S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-pentanoate Openeye Name: methyl (2R,3S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-pentanoate CAS Name: (2R,3S)-2-[(4-bromophenyl)sulfonylamino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl (2R,3S)-2-[(4-bromophenyl)sulfonylamino]-3-methylpentanoate Traditional Name: (2R,3S)-2-(brosylamino)-3-methyl-valeric acid methyl ester Formula: C13H18BrNO4S MolecularWeight: 364.25532

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C13H18BrNO4S/c1-4-9(2)12(13(16)19-3)15-20(17,18)11-7-5-10(14)6-8-11/h5-9,12,15H,4H2,1-3H3/t9-,12+/m0/s1